Compound Detail
CHEMBL3957113
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Basic Information
| ChEMBL ID | CHEMBL3957113 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KDVZJCYZKUTIHP-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
445.3
MW (Da)
2.66
ALogP
6
HBA
2
HBD
84.3
PSA (Ų)
0.75
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ribosomal protein S6 kinase beta-1 CHEMBL4501 | IC50 | 8.24 | 8.24 | 5.8 | 2 |
| Unchecked CHEMBL612545 | IC50 | 8.24 | 8.24 | 5.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Ribosomal protein S6 kinase beta-1 | IC50 | = | 5.8 | nM | 8.24 | Enzyme Assay: P70S6K inhibitor compounds were diluted and plated in 96 well plat... | - |
| Unchecked | IC50 | = | 5.8 | nM | 8.24 | P70S6K Enzyme Assay: P70S6K inhibitor compounds were diluted and plated in 96 we... | - |
| Ribosomal protein S6 kinase beta-1 | IC50 | = | 5.8 | nM | 8.24 | Enzyme Assay: P70S6K inhibitor compounds were diluted and plated in 96 well plat... | - |
Data from ChEMBL 36 via Core Engine